Geometry & MOs

Info

ID:	244587
PubChem CID:	99368076
Reduced:	NSO4C24H25 (1)
Stoich.:	ABC4D24E25 (1)
Weight, g/mol:	360.150764
ΔH_f, kcal/mol:	-103.2
Dipole, Da:	4.2
IP(EA), eV:	-8.98(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-acetamido-N-[(2-hydroxyphenyl)methyl]-N-propyl-3-thiophen-2-ylpropanamide

Drug info:

PubChemData

Smile

CCCN(CC1=CC=CC=C1O)C(=O)C2=CC=CC(=C2)CS(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations